Geometry & MOs

Info

ID:	407608
PubChem CID:	135080357
Reduced:	NSO4C9H21 (1)
Stoich.:	ABC4D9E21 (1)
Weight, g/mol:	199.96036
ΔH_f, kcal/mol:	-204.91
Dipole, Da:	8.85
IP(EA), eV:	-10.73(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-bromo-2-chloro-3-methylbutan-1-ol

Drug info:

PubChemData

Smile

CCCCCC[NH2+]CCCOS(=O)(=O)[O-]

DOS

IR

Vibrations